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(E)-3-(2-((1-ethylquinolin-2(1H)-ylidene)methyl)-7-methylquinolin-1-ium-1-yl)propane-1-sulfonate

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(E)-3-(2-((1-ethylquinolin-2(1H)-ylidene)methyl)-7-methylquinolin-1-ium-1-yl)propane-1-sulfonate
SpectraBase Compound ID 6pb84FkDIJ
InChI InChI=1S/C25H26N2O3S/c1-3-26-22(13-11-20-7-4-5-8-24(20)26)18-23-14-12-21-10-9-19(2)17-25(21)27(23)15-6-16-31(28,29)30/h4-5,7-14,17-18H,3,6,15-16H2,1-2H3
InChIKey DSXDUKLHGXQRQN-UHFFFAOYSA-N
Mol Weight 434.55 g/mol
Molecular Formula C25H26N2O3S
Exact Mass 434.166414 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DHXv1qgF1Tc
Name (E)-3-(2-((1-ethylquinolin-2(1H)-ylidene)methyl)-7-methylquinolin-1-ium-1-yl)propane-1-sulfonate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 434.166413876 u
Formula C25H26N2O3S
InChI InChI=1S/C25H26N2O3S/c1-3-26-22(13-11-20-7-4-5-8-24(20)26)18-23-14-12-21-10-9-19(2)17-25(21)27(23)15-6-16-31(28,29)30/h4-5,7-14,17-18H,3,6,15-16H2,1-2H3
InChIKey DSXDUKLHGXQRQN-UHFFFAOYSA-N
Molecular Weight 434.554 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_7709
Solvent DMSO-d6
Source Vendor ID: NMR/13308520